134828-49-2
3-PYRIDINECARBOXYLIC ACID, 5-(AMINOCARBONYL)-6-((2-METHOXYPHENYL)AMINO)-2-METHYL-, MONOSODIUM SALT
Name3-PYRIDINECARBOXYLIC ACID, 5-(AMINOCARBONYL)-6-((2-METHOXYPHENYL)AMINO)-2-METHYL-, MONOSODIUM SALT
FormulaC15 H14 N3 O4 . Na
1Identification
【Name】
3-PYRIDINECARBOXYLIC ACID, 5-(AMINOCARBONYL)-6-((2-METHOXYPHENYL)AMINO)-2-METHYL-, MONOSODIUM SALT
【CAS】
【MDL】
MFCD01692198
【English Synonyms】
【Formula】
C15 H14 N3 O4 . Na
【MolWeight】
323.283
【Inchi】
InChI=1S/C15H15N3O4.Na/c1-8-9(15(20)21)7-10(13(16)19)14(17-8)18-11-5-3-4-6-12(11)22-2;/h3-7H,1-2H3,(H2,16,19)(H,17,18)(H,20,21);/q;+1/p-1
【InChIKey】
InChIKey=IEGLCZJKLJBAST-UHFFFAOYSA-M
【SMILES】
Cc1c(cc(c(n1)Nc2ccccc2OC)C(=O)N)C(=O)[O-].[Na+]
【MOL File】
3-PYRIDINECARBOXYLIC….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:7
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-PYRIDINECARBOXYLIC ACID, 5-(AMINOCARBONYL)-6-((2-METHOXYPHENYL)AMINO)-2-METHYL-, MONOSODIUM SALT.cml